HEADER    PROTEIN                                 24-FEB-12   NONE
TITLE     NULL                                                        
COMPND    MOLECULE: ChEBI                                             
SOURCE    NULL                                                        
KEYWDS    NULL                                                        
EXPDTA    NULL                                                        
AUTHOR    Marvin                                                      
REVDAT   1   24-FEB-12         0                                  
HETATM    1  C   UNK     0      28.215 -15.989   0.000  0.00  0.00           C+0
HETATM    2  C   UNK     0      29.755 -15.989   0.000  0.00  0.00           C+0
HETATM    3  O   UNK     0      27.445 -17.323   0.000  0.00  0.00           O+0
HETATM    4  O   UNK     0      30.525 -17.323   0.000  0.00  0.00           O+0
HETATM    5  C   UNK     0      27.739 -14.525   0.000  0.00  0.00           C+0
HETATM    6  C   UNK     0      26.406 -13.755   0.000  0.00  0.00           C+0
HETATM    7  O   UNK     0      25.072 -14.525   0.000  0.00  0.00           O+0
HETATM    8  O   UNK     0      23.532 -12.985   0.000  0.00  0.00           O+0
HETATM    9  O   UNK     0      21.992 -14.525   0.000  0.00  0.00           O+0
HETATM   10  P   UNK     0      23.532 -14.525   0.000  0.00  0.00           P+0
HETATM   11  O   UNK     0      23.532 -16.065   0.000  0.00  0.00           O+0
HETATM   12  O   UNK     0      28.985 -13.620   0.000  0.00  0.00           O+0
HETATM   13  C   UNK     0      30.231 -14.525   0.000  0.00  0.00           C+0
HETATM   14  N   UNK     0      31.565 -13.755   0.000  0.00  0.00           N+0
HETATM   15  O   UNK     0      32.899 -16.065   0.000  0.00  0.00           O+0
HETATM   16  C   UNK     0      32.899 -14.525   0.000  0.00  0.00           C+0
HETATM   17  C   UNK     0      34.232 -13.755   0.000  0.00  0.00           C+0
HETATM   18  N   UNK     0      35.566 -14.525   0.000  0.00  0.00           N+0
HETATM   19  C   UNK     0      36.900 -13.755   0.000  0.00  0.00           C+0
HETATM   20  O   UNK     0      38.233 -14.525   0.000  0.00  0.00           O+0
CONECT    1    5    2    3                                                  
CONECT    2    1   13    4                                                  
CONECT    3    1                                                            
CONECT    4    2                                                            
CONECT    5   12    1    6                                                  
CONECT    6    5    7                                                       
CONECT    7    6   10                                                       
CONECT    8   10                                                            
CONECT    9   10                                                            
CONECT   10    7    8    9   11                                             
CONECT   11   10                                                            
CONECT   12    5   13                                                       
CONECT   13   12    2   14                                                  
CONECT   14   13   16                                                       
CONECT   15   16                                                            
CONECT   16   14   15   17                                                  
CONECT   17   16   18                                                       
CONECT   18   17   19                                                       
CONECT   19   18   20                                                       
CONECT   20   19                                                            
MASTER        0    0    0    0    0    0    0    0   20    0   40    0
END